DND
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O13 | PA | doub | 1.48Å | 1.48Å | |
| O14 | PA | sing | 1.61Å | 1.51Å | |
| PA | O3P | sing | 1.61Å | 1.60Å | |
| PA | O5B | sing | 1.61Å | 1.61Å | |
| O11 | PN | doub | 1.48Å | 1.47Å | |
| O3P | PN | sing | 1.61Å | 1.61Å | |
| O5B | C5B | sing | 1.43Å | 1.48Å | |
| PN | O12 | sing | 1.61Å | 1.50Å | |
| PN | O5D | sing | 1.61Å | 1.57Å | |
| C5B | C4B | sing | 1.53Å | 1.54Å | |
| N7A | C8A | doub | 1.30Å | 1.34Å | Aromatic |
| N7A | C5A | sing | 1.36Å | 1.38Å | Aromatic |
| C8A | N9A | sing | 1.36Å | 1.37Å | Aromatic |
| N6A | C6A | sing | 1.38Å | 1.34Å | |
| O5D | C5D | sing | 1.43Å | 1.42Å | |
| C5A | C6A | sing | 1.41Å | 1.43Å | Aromatic |
| C5A | C4A | doub | 1.41Å | 1.39Å | Aromatic |
| O4B | C4B | sing | 1.44Å | 1.46Å | |
| O4B | C1B | sing | 1.44Å | 1.34Å | |
| C6A | N1A | doub | 1.33Å | 1.38Å | Aromatic |
| C4B | C3B | sing | 1.54Å | 1.53Å | |
| N9A | C4A | sing | 1.37Å | 1.36Å | Aromatic |
| N9A | C1B | sing | 1.46Å | 1.46Å | |
| C5D | C4D | sing | 1.53Å | 1.49Å | |
| C3D | O3D | sing | 1.43Å | 1.47Å | |
| C3D | C4D | sing | 1.54Å | 1.54Å | |
| C3D | C2D | sing | 1.55Å | 1.51Å | |
| C4A | N3A | sing | 1.33Å | 1.35Å | Aromatic |
| C1B | C2B | sing | 1.54Å | 1.54Å | |
| N1A | C2A | sing | 1.32Å | 1.38Å | Aromatic |
| C4D | O4D | sing | 1.44Å | 1.43Å | |
| C2B | C3B | sing | 1.55Å | 1.53Å | |
| C2B | O2B | sing | 1.43Å | 1.44Å | |
| C2D | O2D | sing | 1.43Å | 1.45Å | |
| C2D | C1D | sing | 1.55Å | 1.53Å | |
| C3B | O3B | sing | 1.43Å | 1.45Å | |
| N3A | C2A | doub | 1.32Å | 1.32Å | Aromatic |
| O4D | C1D | sing | 1.44Å | 1.41Å | |
| C1D | N1N | sing | 1.47Å | 1.47Å | |
| C6N | N1N | doub | 1.32Å | 1.43Å | Aromatic |
| C6N | C5N | sing | 1.38Å | 1.35Å | Aromatic |
| N1N | C2N | sing | 1.32Å | 1.40Å | Aromatic |
| C5N | C4N | doub | 1.38Å | 1.53Å | Aromatic |
| C2N | C3N | doub | 1.40Å | 1.44Å | Aromatic |
| C4N | C3N | sing | 1.40Å | 1.49Å | Aromatic |
| C3N | C7N | sing | 1.48Å | 1.48Å | |
| C7N | O7N | doub | 1.21Å | 1.35Å | |
| C7N | O8N | sing | 1.35Å | 1.22Å | |
| O12 | H1 | sing | 0.97Å | 0.95Å | |
| C5D | H2 | sing | 1.09Å | 1.10Å | |
| C5D | H3 | sing | 1.09Å | 1.10Å | |
| C4D | H4 | sing | 1.09Å | 1.10Å | |
| C3D | H5 | sing | 1.09Å | 1.10Å | |
| O3D | H6 | sing | 0.97Å | 0.95Å | |
| C2D | H7 | sing | 1.09Å | 1.10Å | |
| O2D | H8 | sing | 0.97Å | 0.95Å | |
| C1D | H9 | sing | 1.09Å | 1.10Å | |
| C6N | H10 | sing | 1.08Å | 1.08Å | |
| C5N | H11 | sing | 1.08Å | 1.08Å | |
| C4N | H12 | sing | 1.08Å | 1.08Å | |
| C2N | H13 | sing | 1.08Å | 1.08Å | |
| O8N | H14 | sing | 0.97Å | 0.95Å | |
| O14 | H15 | sing | 0.97Å | 0.95Å | |
| C5B | H16 | sing | 1.09Å | 1.10Å | |
| C5B | H17 | sing | 1.09Å | 1.10Å | |
| C4B | H18 | sing | 1.09Å | 1.10Å | |
| C3B | H19 | sing | 1.09Å | 1.10Å | |
| O3B | H20 | sing | 0.97Å | 0.95Å | |
| C2B | H21 | sing | 1.09Å | 1.10Å | |
| O2B | H22 | sing | 0.97Å | 0.95Å | |
| C1B | H23 | sing | 1.09Å | 1.10Å | |
| C2A | H24 | sing | 1.08Å | 1.08Å | |
| C8A | H25 | sing | 1.08Å | 1.08Å | |
| N6A | H26 | sing | 0.97Å | 1.00Å | |
| N6A | H27 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O13 | PA | O14 | 113.5° | 109.4° |
| O13 | PA | O3P | 104.4° | 109.5° |
| O13 | PA | O5B | 107.0° | 109.4° |
| O14 | PA | O3P | 113.7° | 109.5° |
| O14 | PA | O5B | 109.1° | 109.5° |
| PA | O14 | H15 | 109.5° | 114.0° |
| O3P | PA | O5B | 108.8° | 109.5° |
| PA | O3P | PN | 131.5° | 134.0° |
| PA | O5B | C5B | 120.8° | 123.0° |
| O11 | PN | O3P | 116.7° | 109.4° |
| O11 | PN | O12 | 111.5° | 109.5° |
| O11 | PN | O5D | 110.2° | 109.5° |
| O3P | PN | O12 | 109.2° | 109.5° |
| O3P | PN | O5D | 92.5° | 109.5° |
| O5B | C5B | C4B | 105.6° | 109.4° |
| O5B | C5B | H16 | 110.4° | 109.5° |
| O5B | C5B | H17 | 110.4° | 109.5° |
| O12 | PN | O5D | 115.5° | 109.5° |
| PN | O12 | H1 | 109.5° | 113.9° |
| PN | O5D | C5D | 119.7° | 123.0° |
| C5B | C4B | O4B | 111.8° | 110.4° |
| C5B | C4B | C3B | 114.3° | 110.4° |
| C4B | C5B | H16 | 110.4° | 109.4° |
| C4B | C5B | H17 | 110.4° | 109.5° |
| C5B | C4B | H18 | 108.1° | 110.3° |
| C8A | N7A | C5A | 102.0° | 109.4° |
| N7A | C8A | N9A | 113.9° | 110.0° |
| N7A | C8A | H25 | 123.0° | 125.0° |
| N7A | C5A | C6A | 131.2° | 134.7° |
| N7A | C5A | C4A | 112.3° | 107.1° |
| C8A | N9A | C4A | 106.5° | 107.4° |
| C8A | N9A | C1B | 127.6° | 126.3° |
| N9A | C8A | H25 | 123.0° | 125.0° |
| N6A | C6A | C5A | 124.0° | 120.8° |
| N6A | C6A | N1A | 118.6° | 120.8° |
| C6A | N6A | H26 | 109.5° | 120.0° |
| C6A | N6A | H27 | 109.5° | 120.0° |
| O5D | C5D | C4D | 103.5° | 109.5° |
| O5D | C5D | H2 | 110.9° | 109.5° |
| O5D | C5D | H3 | 110.9° | 109.5° |
| C6A | C5A | C4A | 116.5° | 118.2° |
| C5A | C6A | N1A | 117.4° | 118.4° |
| C5A | C4A | N9A | 105.3° | 106.0° |
| C5A | C4A | N3A | 127.4° | 119.1° |
| C4B | O4B | C1B | 110.8° | 105.3° |
| O4B | C4B | C3B | 105.1° | 104.8° |
| O4B | C4B | H18 | 109.1° | 110.5° |
| O4B | C1B | N9A | 106.8° | 110.4° |
| O4B | C1B | C2B | 100.2° | 104.8° |
| O4B | C1B | H23 | 113.9° | 110.4° |
| C6A | N1A | C2A | 118.8° | 121.2° |
| C4B | C3B | C2B | 100.4° | 104.0° |
| C4B | C3B | O3B | 111.1° | 110.5° |
| C3B | C4B | H18 | 108.2° | 110.4° |
| C4B | C3B | H19 | 108.9° | 110.5° |
| C4A | N9A | C1B | 125.9° | 126.3° |
| N9A | C4A | N3A | 127.3° | 134.9° |
| N9A | C1B | C2B | 112.8° | 110.3° |
| N9A | C1B | H23 | 111.9° | 110.4° |
| C5D | C4D | C3D | 115.1° | 109.9° |
| C5D | C4D | O4D | 105.5° | 109.9° |
| C4D | C5D | H2 | 110.9° | 109.5° |
| C4D | C5D | H3 | 110.9° | 109.5° |
| C5D | C4D | H4 | 109.8° | 109.9° |
| O3D | C3D | C4D | 110.7° | 110.5° |
| O3D | C3D | C2D | 110.6° | 110.4° |
| O3D | C3D | H5 | 111.7° | 110.4° |
| C3D | O3D | H6 | 109.5° | 114.0° |
| C4D | C3D | C2D | 101.7° | 104.2° |
| C3D | C4D | O4D | 106.6° | 107.3° |
| C3D | C4D | H4 | 109.1° | 110.0° |
| C4D | C3D | H5 | 110.7° | 110.5° |
| C3D | C2D | O2D | 111.7° | 110.9° |
| C3D | C2D | C1D | 100.7° | 102.1° |
| C2D | C3D | H5 | 111.1° | 110.6° |
| C3D | C2D | H7 | 109.9° | 110.9° |
| C4A | N3A | C2A | 112.4° | 120.6° |
| C1B | C2B | C3B | 101.9° | 104.0° |
| C1B | C2B | O2B | 113.6° | 110.5° |
| C1B | C2B | H21 | 109.0° | 110.6° |
| C2B | C1B | H23 | 110.7° | 110.4° |
| N1A | C2A | N3A | 127.6° | 122.5° |
| N1A | C2A | H24 | 116.2° | 118.8° |
| C4D | O4D | C1D | 109.5° | 107.0° |
| O4D | C4D | H4 | 110.7° | 109.8° |
| C3B | C2B | O2B | 112.6° | 110.5° |
| C2B | C3B | O3B | 116.9° | 110.5° |
| C2B | C3B | H19 | 108.9° | 110.7° |
| C3B | C2B | H21 | 109.1° | 110.5° |
| O2B | C2B | H21 | 110.3° | 110.5° |
| C2B | O2B | H22 | 109.5° | 114.0° |
| O2D | C2D | C1D | 113.7° | 110.9° |
| O2D | C2D | H7 | 110.8° | 110.8° |
| C2D | O2D | H8 | 109.5° | 114.0° |
| C2D | C1D | O4D | 105.3° | 103.5° |
| C2D | C1D | N1N | 111.1° | 110.6° |
| C1D | C2D | H7 | 109.6° | 111.0° |
| C2D | C1D | H9 | 108.5° | 110.6° |
| O3B | C3B | H19 | 110.0° | 110.4° |
| C3B | O3B | H20 | 109.5° | 114.1° |
| N3A | C2A | H24 | 116.2° | 118.7° |
| O4D | C1D | N1N | 112.5° | 110.6° |
| O4D | C1D | H9 | 110.1° | 110.6° |
| C1D | N1N | C6N | 124.0° | 119.0° |
| C1D | N1N | C2N | 117.3° | 119.0° |
| N1N | C1D | H9 | 109.3° | 110.7° |
| N1N | C6N | C5N | 123.4° | 121.1° |
| C6N | N1N | C2N | 118.7° | 121.9° |
| N1N | C6N | H10 | 118.3° | 119.5° |
| C6N | C5N | C4N | 120.8° | 119.3° |
| C5N | C6N | H10 | 118.3° | 119.4° |
| C6N | C5N | H11 | 119.6° | 120.4° |
| N1N | C2N | C3N | 122.9° | 120.5° |
| N1N | C2N | H13 | 118.5° | 119.7° |
| C5N | C4N | C3N | 115.5° | 118.3° |
| C4N | C5N | H11 | 119.6° | 120.3° |
| C5N | C4N | H12 | 122.2° | 120.9° |
| C2N | C3N | C4N | 118.7° | 118.9° |
| C2N | C3N | C7N | 115.0° | 120.6° |
| C3N | C2N | H13 | 118.5° | 119.7° |
| C4N | C3N | C7N | 126.3° | 120.5° |
| C3N | C4N | H12 | 122.3° | 120.8° |
| C3N | C7N | O7N | 124.7° | 120.0° |
| C3N | C7N | O8N | 113.3° | 120.0° |
| O7N | C7N | O8N | 122.0° | 120.0° |
| C7N | O8N | H14 | 109.5° | 117.0° |
| H2 | C5D | H3 | 109.5° | 109.4° |
| H16 | C5B | H17 | 109.5° | 109.5° |
| H26 | N6A | H27 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O13 | PA | O14 | O3P | 119.1° | 120.0° |
| O13 | PA | O14 | O5B | 119.3° | 120.0° |
| O13 | PA | O3P | O5B | 114.0° | 120.0° |
| O13 | PA | O3P | PN | 143.0° | 40.0° |
| O13 | PA | O5B | C5B | 52.0° | 55.0° |
| O13 | PA | O14 | H15 | 0.0° | 180.0° |
| O14 | PA | O3P | O5B | 121.8° | 120.0° |
| O14 | PA | O3P | PN | 18.8° | 80.0° |
| O14 | PA | O5B | C5B | 175.2° | 65.0° |
| PA | O3P | PN | O11 | 91.2° | 45.0° |
| O3P | PA | O5B | C5B | 60.2° | 175.0° |
| PA | O3P | PN | O12 | 36.4° | 74.9° |
| PA | O3P | PN | O5D | 154.6° | 165.1° |
| O3P | PA | O14 | H15 | 119.1° | 60.0° |
| O5B | PA | O3P | PN | 103.0° | 160.0° |
| PA | O5B | C5B | C4B | 162.0° | 180.0° |
| O5B | PA | O14 | H15 | 119.3° | 60.1° |
| PA | O5B | C5B | H16 | 42.6° | 60.0° |
| PA | O5B | C5B | H17 | 78.6° | 60.0° |
| O11 | PN | O3P | O12 | 127.6° | 120.0° |
| O11 | PN | O3P | O5D | 114.2° | 120.0° |
| O11 | PN | O12 | O5D | 126.9° | 120.0° |
| O11 | PN | O5D | C5D | 56.2° | 55.0° |
| O11 | PN | O12 | H1 | 0.0° | 180.0° |
| O3P | PN | O12 | O5D | 102.6° | 120.0° |
| O3P | PN | O5D | C5D | 176.0° | 175.0° |
| O3P | PN | O12 | H1 | 130.5° | 60.0° |
| O5B | C5B | C4B | H16 | 119.4° | 120.0° |
| O5B | C5B | C4B | H17 | 119.4° | 120.0° |
| O5B | C5B | C4B | O4B | 51.1° | 69.6° |
| O5B | C5B | C4B | C3B | 68.1° | 175.0° |
| O5B | C5B | H16 | H17 | 121.8° | 120.1° |
| O5B | C5B | C4B | H18 | 171.3° | 52.7° |
| O12 | PN | O5D | C5D | 71.3° | 65.0° |
| PN | O5D | C5D | C4D | 179.7° | 180.0° |
| O5D | PN | O12 | H1 | 126.9° | 60.0° |
| PN | O5D | C5D | H2 | 60.6° | 60.0° |
| PN | O5D | C5D | H3 | 61.3° | 59.9° |
| C5B | C4B | O4B | C3B | 124.5° | 118.8° |
| C5B | C4B | O4B | H18 | 119.6° | 122.2° |
| C5B | C4B | O4B | C1B | 142.1° | 159.4° |
| C5B | C4B | C3B | H18 | 120.6° | 122.2° |
| C5B | C4B | C3B | C2B | 109.8° | 142.8° |
| C5B | C4B | C3B | O3B | 125.9° | 98.6° |
| C4B | C5B | H16 | H17 | 121.8° | 120.0° |
| C5B | C4B | C3B | H19 | 4.5° | 24.0° |
| N7A | C8A | N9A | H25 | 180.0° | 179.6° |
| C8A | N7A | C5A | C6A | 179.6° | 179.7° |
| C8A | N7A | C5A | C4A | 0.2° | 0.4° |
| N7A | C8A | N9A | C4A | 0.1° | 0.4° |
| N7A | C8A | N9A | C1B | 179.7° | 179.8° |
| C5A | N7A | C8A | N9A | 0.2° | 0.5° |
| N7A | C5A | C6A | N6A | 0.1° | 0.1° |
| N7A | C5A | C6A | C4A | 179.8° | 179.9° |
| N7A | C5A | C6A | N1A | 180.0° | 180.0° |
| N7A | C5A | C4A | N9A | 0.2° | 0.1° |
| N7A | C5A | C4A | N3A | 179.8° | 180.0° |
| C5A | N7A | C8A | H25 | 179.8° | 179.9° |
| C8A | N9A | C4A | C5A | 0.0° | 0.2° |
| C8A | N9A | C1B | O4B | 59.1° | 23.2° |
| C8A | N9A | C4A | C1B | 179.8° | 179.8° |
| C8A | N9A | C4A | N3A | 179.9° | 179.7° |
| C8A | N9A | C1B | C2B | 50.0° | 92.2° |
| C8A | N9A | C1B | H23 | 175.6° | 145.6° |
| N6A | C6A | C5A | N1A | 179.8° | 179.9° |
| N6A | C6A | C5A | C4A | 179.6° | 179.9° |
| N6A | C6A | N1A | C2A | 179.9° | 179.9° |
| C6A | N6A | H26 | H27 | 120.0° | 179.9° |
| O5D | C5D | C4D | H2 | 119.1° | 120.0° |
| O5D | C5D | C4D | H3 | 119.0° | 120.1° |
| O5D | C5D | C4D | C3D | 93.9° | 175.7° |
| O5D | C5D | C4D | O4D | 149.0° | 66.4° |
| O5D | C5D | H2 | H3 | 122.7° | 120.0° |
| O5D | C5D | C4D | H4 | 29.7° | 54.5° |
| C6A | C5A | C4A | N9A | 179.6° | 180.0° |
| C6A | C5A | C4A | N3A | 0.4° | 0.1° |
| C5A | C6A | N1A | C2A | 0.0° | 0.0° |
| C5A | C6A | N6A | H26 | 179.8° | 180.0° |
| C5A | C6A | N6A | H27 | 59.8° | 0.1° |
| C4A | C5A | C6A | N1A | 0.2° | 0.0° |
| C5A | C4A | N9A | N3A | 180.0° | 179.8° |
| C5A | C4A | N9A | C1B | 179.9° | 180.0° |
| C5A | C4A | N3A | C2A | 0.2° | 0.1° |
| O4B | C4B | C3B | H18 | 116.5° | 119.0° |
| C4B | O4B | C1B | N9A | 157.5° | 159.3° |
| C4B | O4B | C1B | C2B | 39.7° | 40.5° |
| O4B | C4B | C3B | C2B | 13.1° | 24.0° |
| O4B | C4B | C3B | O3B | 111.2° | 142.6° |
| O4B | C4B | C5B | H16 | 170.5° | 50.4° |
| O4B | C4B | C5B | H17 | 68.3° | 170.4° |
| O4B | C4B | C3B | H19 | 127.4° | 94.8° |
| C4B | O4B | C1B | H23 | 78.4° | 78.3° |
| C1B | O4B | C4B | C3B | 17.6° | 40.5° |
| O4B | C1B | N9A | C4A | 121.1° | 156.5° |
| O4B | C1B | N9A | C2B | 109.1° | 115.4° |
| O4B | C1B | N9A | H23 | 125.3° | 122.3° |
| O4B | C1B | C2B | H23 | 120.5° | 118.9° |
| O4B | C1B | C2B | C3B | 46.6° | 24.0° |
| O4B | C1B | C2B | O2B | 168.0° | 142.6° |
| C1B | O4B | C4B | H18 | 98.3° | 78.4° |
| O4B | C1B | C2B | H21 | 68.6° | 94.7° |
| C6A | N1A | C2A | N3A | 0.2° | 0.0° |
| C6A | N1A | C2A | H24 | 179.8° | 179.9° |
| N1A | C6A | N6A | H26 | 0.0° | 0.1° |
| N1A | C6A | N6A | H27 | 120.0° | 180.0° |
| C4B | C3B | C2B | C1B | 35.0° | 0.0° |
| C4B | C3B | C2B | O3B | 120.2° | 118.6° |
| C4B | C3B | C2B | H19 | 114.3° | 118.7° |
| C4B | C3B | C2B | O2B | 157.1° | 118.6° |
| C4B | C3B | O3B | H19 | 120.7° | 122.6° |
| C3B | C4B | C5B | H16 | 51.3° | 65.0° |
| C3B | C4B | C5B | H17 | 172.5° | 55.0° |
| C4B | C3B | O3B | H20 | 180.0° | 180.0° |
| C4B | C3B | C2B | H21 | 80.0° | 118.8° |
| C4A | N9A | C1B | C2B | 129.8° | 88.1° |
| N9A | C4A | N3A | C2A | 179.8° | 179.9° |
| C4A | N9A | C1B | H23 | 4.2° | 34.2° |
| C4A | N9A | C8A | H25 | 179.9° | 180.0° |
| C1B | N9A | C4A | N3A | 0.1° | 0.1° |
| N9A | C1B | C2B | H23 | 126.3° | 122.3° |
| N9A | C1B | C2B | C3B | 159.8° | 142.8° |
| N9A | C1B | C2B | O2B | 78.8° | 98.6° |
| N9A | C1B | C2B | H21 | 44.6° | 24.2° |
| C1B | N9A | C8A | H25 | 0.2° | 0.2° |
| C5D | C4D | C3D | O3D | 150.7° | 119.9° |
| C5D | C4D | C3D | O4D | 116.6° | 119.4° |
| C5D | C4D | C3D | H4 | 123.9° | 121.1° |
| C5D | C4D | C3D | C2D | 91.8° | 121.5° |
| C5D | C4D | O4D | H4 | 118.7° | 121.0° |
| C5D | C4D | O4D | C1D | 122.3° | 145.9° |
| C4D | C5D | H2 | H3 | 122.7° | 120.0° |
| C5D | C4D | C3D | H5 | 26.3° | 2.6° |
| O3D | C3D | C4D | C2D | 117.5° | 118.6° |
| O3D | C3D | C4D | H5 | 124.4° | 122.5° |
| O3D | C3D | C2D | H5 | 124.6° | 122.5° |
| O3D | C3D | C4D | O4D | 92.8° | 120.7° |
| O3D | C3D | C2D | O2D | 40.6° | 20.4° |
| O3D | C3D | C2D | C1D | 80.4° | 97.8° |
| O3D | C3D | C4D | H4 | 26.7° | 1.2° |
| O3D | C3D | C2D | H7 | 164.0° | 143.9° |
| C4D | C3D | C2D | H5 | 117.8° | 118.8° |
| C3D | C4D | O4D | H4 | 118.5° | 119.6° |
| C4D | C3D | C2D | O2D | 158.2° | 139.1° |
| C4D | C3D | C2D | C1D | 37.2° | 20.8° |
| C3D | C4D | O4D | C1D | 0.5° | 26.5° |
| C3D | C4D | C5D | H2 | 147.1° | 64.2° |
| C3D | C4D | C5D | H3 | 25.2° | 55.7° |
| C4D | C3D | O3D | H6 | 180.0° | 179.9° |
| C4D | C3D | C2D | H7 | 78.4° | 97.4° |
| C2D | C3D | C4D | O4D | 24.7° | 2.0° |
| C3D | C2D | O2D | C1D | 113.2° | 112.7° |
| C3D | C2D | O2D | H7 | 122.9° | 123.6° |
| C3D | C2D | C1D | H7 | 115.8° | 118.2° |
| C3D | C2D | C1D | O4D | 38.6° | 37.0° |
| C3D | C2D | C1D | N1N | 160.7° | 155.5° |
| C2D | C3D | C4D | H4 | 144.2° | 117.4° |
| C2D | C3D | O3D | H6 | 68.0° | 65.3° |
| C3D | C2D | O2D | H8 | 180.0° | 61.5° |
| C3D | C2D | C1D | H9 | 79.2° | 81.5° |
| C4A | N3A | C2A | N1A | 0.1° | 0.1° |
| C4A | N3A | C2A | H24 | 179.9° | 180.0° |
| C1B | C2B | C3B | O2B | 122.1° | 118.7° |
| C1B | C2B | C3B | H21 | 115.1° | 118.7° |
| C1B | C2B | O2B | H21 | 122.7° | 122.8° |
| C1B | C2B | C3B | O3B | 85.2° | 118.6° |
| C1B | C2B | C3B | H19 | 149.3° | 118.7° |
| C1B | C2B | O2B | H22 | 180.0° | 176.1° |
| N1A | C2A | N3A | H24 | 180.0° | 179.9° |
| C4D | O4D | C1D | C2D | 23.9° | 40.0° |
| C4D | O4D | C1D | N1N | 145.0° | 158.5° |
| O4D | C4D | C5D | H2 | 29.9° | 53.6° |
| O4D | C4D | C5D | H3 | 92.0° | 173.5° |
| O4D | C4D | C3D | H5 | 142.8° | 116.8° |
| C4D | O4D | C1D | H9 | 92.8° | 78.5° |
| C3B | C2B | O2B | H21 | 122.1° | 122.6° |
| C2B | C3B | O3B | H19 | 124.9° | 122.8° |
| C2B | C3B | C4B | H18 | 129.7° | 95.0° |
| C2B | C3B | O3B | H20 | 65.7° | 65.4° |
| C3B | C2B | O2B | H22 | 64.8° | 61.5° |
| C3B | C2B | C1B | H23 | 74.0° | 94.9° |
| O2B | C2B | C3B | O3B | 36.9° | 0.0° |
| O2B | C2B | C3B | H19 | 88.6° | 122.6° |
| O2B | C2B | C1B | H23 | 47.5° | 23.7° |
| O2D | C2D | C1D | H7 | 124.6° | 123.6° |
| O2D | C2D | C1D | O4D | 158.2° | 155.2° |
| O2D | C2D | C1D | N1N | 79.8° | 86.3° |
| O2D | C2D | C3D | H5 | 84.0° | 102.1° |
| O2D | C2D | C1D | H9 | 40.4° | 36.7° |
| C2D | C1D | O4D | N1N | 121.1° | 118.5° |
| C2D | C1D | O4D | H9 | 116.7° | 118.5° |
| C2D | C1D | N1N | H9 | 119.6° | 123.0° |
| C2D | C1D | N1N | C6N | 72.3° | 75.3° |
| C2D | C1D | N1N | C2N | 106.5° | 104.4° |
| C1D | C2D | C3D | H5 | 155.0° | 139.6° |
| C1D | C2D | O2D | H8 | 66.8° | 174.2° |
| O3B | C3B | C4B | H18 | 5.3° | 23.6° |
| O3B | C3B | C2B | H21 | 159.7° | 122.6° |
| O4D | C1D | N1N | H9 | 122.6° | 122.9° |
| O4D | C1D | N1N | C6N | 45.5° | 38.8° |
| O4D | C1D | N1N | C2N | 135.8° | 141.5° |
| C1D | O4D | C4D | H4 | 119.0° | 93.1° |
| O4D | C1D | C2D | H7 | 77.2° | 81.2° |
| C1D | N1N | C6N | C2N | 178.7° | 179.7° |
| C1D | N1N | C6N | C5N | 178.7° | 180.0° |
| C1D | N1N | C2N | C3N | 178.3° | 179.8° |
| N1N | C1D | C2D | H7 | 44.9° | 37.3° |
| C1D | N1N | C6N | H10 | 1.3° | 0.0° |
| C1D | N1N | C2N | H13 | 1.7° | 0.0° |
| N1N | C6N | C5N | H10 | 180.0° | 180.0° |
| N1N | C6N | C5N | C4N | 0.5° | 0.0° |
| C6N | N1N | C2N | C3N | 0.5° | 0.5° |
| C6N | N1N | C1D | H9 | 168.1° | 161.7° |
| N1N | C6N | C5N | H11 | 179.5° | 180.0° |
| C6N | N1N | C2N | H13 | 179.5° | 179.8° |
| C5N | C6N | N1N | C2N | 0.0° | 0.3° |
| C6N | C5N | C4N | H11 | 180.0° | 180.0° |
| C6N | C5N | C4N | C3N | 0.6° | 0.0° |
| C6N | C5N | C4N | H12 | 179.4° | 179.9° |
| N1N | C2N | C3N | H13 | 180.0° | 179.7° |
| N1N | C2N | C3N | C4N | 0.4° | 0.5° |
| N1N | C2N | C3N | C7N | 179.2° | 179.7° |
| C2N | N1N | C1D | H9 | 13.1° | 18.5° |
| C2N | N1N | C6N | H10 | 179.9° | 179.7° |
| C5N | C4N | C3N | C2N | 0.1° | 0.2° |
| C5N | C4N | C3N | H12 | 180.0° | 179.9° |
| C5N | C4N | C3N | C7N | 179.7° | 180.0° |
| C4N | C5N | C6N | H10 | 179.5° | 180.0° |
| C2N | C3N | C4N | C7N | 179.5° | 179.8° |
| C2N | C3N | C7N | O7N | 0.9° | 0.2° |
| C2N | C3N | C7N | O8N | 178.9° | 179.8° |
| C2N | C3N | C4N | H12 | 179.9° | 179.8° |
| C4N | C3N | C7N | O7N | 179.6° | 180.0° |
| C4N | C3N | C7N | O8N | 0.6° | 0.0° |
| C3N | C4N | C5N | H11 | 179.4° | 180.0° |
| C4N | C3N | C2N | H13 | 179.6° | 179.8° |
| C3N | C7N | O7N | O8N | 179.8° | 180.0° |
| C7N | C3N | C4N | H12 | 0.3° | 0.0° |
| C7N | C3N | C2N | H13 | 0.8° | 0.0° |
| C3N | C7N | O8N | H14 | 179.8° | 180.0° |
| O7N | C7N | O8N | H14 | 0.0° | 0.0° |
| H2 | C5D | C4D | H4 | 89.4° | 174.5° |
| H3 | C5D | C4D | H4 | 148.7° | 65.5° |
| H4 | C4D | C3D | H5 | 97.7° | 123.7° |
| H5 | C3D | O3D | H6 | 56.2° | 57.4° |
| H5 | C3D | C2D | H7 | 39.4° | 21.4° |
| H7 | C2D | O2D | H8 | 57.1° | 62.1° |
| H7 | C2D | C1D | H9 | 165.0° | 160.3° |
| H10 | C6N | C5N | H11 | 0.5° | 0.0° |
| H11 | C5N | C4N | H12 | 0.6° | 0.0° |
| H16 | C5B | C4B | H18 | 69.3° | 172.7° |
| H17 | C5B | C4B | H18 | 51.9° | 67.3° |
| H18 | C4B | C3B | H19 | 116.1° | 146.2° |
| H19 | C3B | O3B | H20 | 59.3° | 57.4° |
| H19 | C3B | C2B | H21 | 34.3° | 0.0° |
| H21 | C2B | O2B | H22 | 57.3° | 61.1° |
| H21 | C2B | C1B | H23 | 170.9° | 146.5° |
